1-[(2,5-dimethoxyphenyl)amino]-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(2,5-dimethoxyphenyl)amino]-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-benzyl-1-(2,5-dimethoxyanilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(2,5-dimethoxyanilino)-3-methyl-2-(phenylmethyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-benzyl-1-(2,5-dimethoxyanilino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-benzyl-1-(2,5-dimethoxyanilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C28H24N4O2 MolecularWeight: 448.51576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=CC=C4)NC5=C(C=CC(=C5)OC)OC)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=CC=C4)NC5=C(C=CC(=C5)OC)OC)C#N

InChI

InChI=1S/C28H24N4O2/c1-18-21(15-19-9-5-4-6-10-19)27(31-24-16-20(33-2)13-14-26(24)34-3)32-25-12-8-7-11-23(25)30-28(32)22(18)17-29/h4-14,16,31H,15H2,1-3H3